SCHEMBL23255178

SCHEMBL23255178

C/C1=C/c2ccccc2N(I)C(=O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ USP2 O75604 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ PLIN1 O60240 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ GSR P00390 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ HSPD1 P10809 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ UCHL3 P15374 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23569635 0.88 MEN1 (0.38) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL26224170 0.81 TTR (0.52) ALDH1A1MAPTLMNAHPGDCES1
SCHEMBL23254941 0.77 HTR1A (0.50) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL21649965 0.72 TTR (0.55) MEN1KMT2AMAPTMAPK1ATM
SCHEMBL487827 0.72 POLB (0.48) MEN1KMT2AMAPTPLIN1LMNA
SCHEMBL12459415 0.71 GPR84 (0.54) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL26698297 0.70 NPC1 (0.36) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL28503423 0.70 POLB (0.46) MEN1KMT2AMAPTPLIN1LMNA
SCHEMBL17861314 0.68 CDC25B (0.74) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL7270394 0.68 — —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3808783-A1 NOVEL CROSSLINKED ALGINIC ACID Mochida Pharmaceutical Co., Ltd. (JP) 2021-04-21 — — EP disclosed
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